N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine

C40H25NO2 — CID 176844569

IUPACN-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(-c2cc3ccccc3c3c2oc2cccc(N(c4ccccc4)c4cccc5oc6ccccc6c45)c23)cc1
InChIInChI=1S/C40H25NO2/c1-3-13-26(14-4-1)31-25-27-15-7-8-18-29(27)38-39-33(21-12-24-36(39)43-40(31)38)41(28-16-5-2-6-17-28)32-20-11-23-35-37(32)30-19-9-10-22-34(30)42-35/h1-25H
InChIKeyQFRBGPYSLLPRAC-UHFFFAOYSA-N
MW551.65 g/mol
LogP11.78
Rot. Bonds4

About N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine

N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine (PubChem CID 176844569) has the molecular formula C40H25NO2 and a molecular weight of 551.65 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine.

Molecular Properties

Compound NameN-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
PubChem CID176844569
Molecular FormulaC40H25NO2
Molecular Weight551.65 g/mol
Exact Mass551.19
IUPAC NameN-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(-c2cc3ccccc3c3c2oc2cccc(N(c4ccccc4)c4cccc5oc6ccccc6c45)c23)cc1
InChIInChI=1S/C40H25NO2/c1-3-13-26(14-4-1)31-25-27-15-7-8-18-29(27)38-39-33(21-12-24-36(39)43-40(31)38)41(28-16-5-2-6-17-28)32-20-11-23-35-37(32)30-19-9-10-22-34(30)42-35/h1-25H
InChIKeyQFRBGPYSLLPRAC-UHFFFAOYSA-N
XLogP11.78
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500551.65
LogP ≤ 511.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-8-amine
CID 176844230
N-dibenzofuran-1-yl-N,5-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
CID 170301528
11-phenyl-N,N-bis(4-phenylphenyl)-9-oxapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1,3,5,7,10,12,14,16,18,20-decaen-14-amine
CID 166569969
N-[4-(3-phenylnaphthalen-2-yl)phenyl]-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 154605463
1-N,6-N-diphenyl-1-N,6-N-bis(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)pyrene-1,6-diamine;1-N,6-N-diphenyl-1-N,6-N-bis(6-phenylnaphtho[2,1-b][1]benzofuran-11-yl)pyrene-1,6-diamine;1-N-naphtho[2,1-b][1]benzofuran-6-yl-6-N-naphtho[2,1-b][1]benzofuran-8-yl-1-N,6-N-diphenylpyrene-1,6-diamine
CID 157353802
N-(4-phenanthren-9-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine
CID 163411525
N-phenyl-6-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)naphtho[2,1-b][1]benzofuran-11-amine
CID 174320690
N,N-dinaphthalen-2-yl-6-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 174320717
N-(5-naphthalen-1-yl-2-phenylphenyl)-N-phenyldibenzofuran-1-amine
CID 167234331
N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine
CID 176844324
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 134337496
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-4-phenyl-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]aniline
CID 134337497

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine?
The IUPAC name of N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine (CID 176844569) is N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine.
What is the SMILES notation for N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine?
The canonical SMILES for N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine is c1ccc(-c2cc3ccccc3c3c2oc2cccc(N(c4ccccc4)c4cccc5oc6ccccc6c45)c23)cc1.
What is the InChIKey of N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine?
The InChIKey is QFRBGPYSLLPRAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H25NO2/c1-3-13-26(14-4-1)31-25-27-15-7-8-18-29(27)38-39-33(21-12-24-36(39)43-40(31)38)41(28-16-5-2-6-17-28)32-20-11-23-35-37(32)30-19-9-10-22-34(30)42-35/h1-25H.
What are the key properties of N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine?
N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine has a molecular weight of 551.65 g/mol, XLogP of 11.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-1-yl-N,6-diphenylnaphtho[2,1-b][1]benzofuran-11-amine is sourced from PubChem (CID 176844569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).